SCHEMBL4770

SCHEMBL4770

O=C(O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 4/20 0.77
OPRM1 P35372 3/20 0.77
CYP2C19 P33261 3/20 0.77
ADRA2A P08913 2/20 0.77
CYP2B6 P20813 2/20 0.77
DRD1 P21728 2/20 0.77
OPRK1 P41145 2/20 0.77
HTR2B P41595 2/20 0.77
KCNH2 Q12809 2/20 0.77
CHRM2 P08172 2/20 0.77
P2RY12 Q9H244 2/20 0.77
THRB P10828 1/20 0.77
NR1I2 O75469 1/20 0.77
HTR2A P28223 1/20 0.77
SLC6A4 P31645 1/20 0.77
CYP2C8 P10632 1/20 0.63
CES1 P23141 1/20 0.63
ADORA3 P0DMS8 2/20 0.47
ALDH1A1 P00352 2/20 0.47
USP2 O75604 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13403893 1.00 ABCB11 (0.77) ABCB11OPRM1CYP2C19ADRA2ACYP2B6
SCHEMBL30277249 1.00 ABCB11 (0.77) ABCB11OPRM1CYP2C19ADRA2ACYP2B6
SCHEMBL233523 1.00 ABCB11 (0.77) ABCB11OPRM1CYP2C19ADRA2ACYP2B6
SCHEMBL3173500 1.00 ABCB11 (0.77) ABCB11OPRM1CYP2C19ADRA2ACYP2B6
SCHEMBL364610 1.00 ABCB11 (0.77) ABCB11OPRM1CYP2C19ADRA2ACYP2B6
SCHEMBL19148650 1.00 ABCB11 (0.77) ABCB11OPRM1CYP2C19ADRA2ACYP2B6
Water SCHEMBL3377943 0.99 ABCB11 (0.76) ABCB11OPRM1CYP2C19ADRA2ACYP2B6
Hydrochloric Acid SCHEMBL6635560 0.99 ABCB11 (0.76) ABCB11OPRM1CYP2C19ADRA2ACYP2B6
Bromide SCHEMBL1130039 0.99 ABCB11 (0.76) ABCB11OPRM1CYP2C19ADRA2ACYP2B6
Iodide SCHEMBL1402210 0.99 ABCB11 (0.76) ABCB11OPRM1CYP2C19ADRA2ACYP2B6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Appears in 48886 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4747263-A1 LIPID NANOPARTICLES AND USES THEREOF University of Connecticut (US) 2026-05-27 EP claimed
US-20260140098-A1 METHOD FOR TREATING PLASMA SAMPLE CONTAINING (7aS,2'S)-2-OXO-CLOPIDOGREL AND METHOD FOR DETERMINING THE SAME CHENGDU SHIBEIKANG BIOMEDICAL TECH CO LTD (CN) 2026-05-21 US claimed
WO-2026103722-A1 COMPOSITIONS AND METHODS FOR INHIBITING EXPRESSION OF COAGULATION FACTOR XI (FXI) SHANGHAI ARGO BIOPHARMACEUTICAL CO., LTD. (CN) 2026-05-21 WO claimed
WO-2026098615-A1 COMPOUND, PHARMACEUTICAL COMPOSITION, AND USE THEREOF IN PREPARATION OF DRUGS FOR TREATING CARDIOVASCULAR AND CEREBROVASCULAR DISEASES 上海东西智荟生物医药有限公司 2026-05-15 WO claimed
EP-4313104-B1 DC009 FOR TREATING ACUTE ISCHEMIC STROKE LUMOSA THERAPEUTICS CO LTD (TW) 2026-05-13 EP claimed
EP-4119139-B1 ICARITIN FOR USE IN THE TREATMENT OF A BLEEDING DISORDER CAUSED BY PLATELET DYSFUNCTION LUNAN PHARMACEUTICAL GROUP CORP (CN) 2026-05-13 EP claimed
US-20260124188-A1 mGluR receptor antagonists for use in prevention andor treatment of bone marrow lesions (BML) andor osteoporosis, cartilage loss, osteosclerosis and osteitis in a mammal ORPHELION AB (SE) 2026-05-07 US claimed
EP-4255391-B1 LUMINOL FOR USE IN THE TREATMENT OF SEQUELAE OF A SARS-COV-2 INFECTION METRIOPHARM AG (CH) 2026-05-06 EP claimed
US-20260115192-A1 PHARMACEUTICAL COMPOSITIONS SHENZHEN PHARMACIN CO LTD (CN) 2026-04-30 US claimed
EP-3996700-B1 TREATMENT OF PATIENTS UNDER ANTIPLATELET MEDICATION EXPERIENCING BLEEDING FAELKER KNUT (SE) 2026-04-29 EP claimed
US-5753702-A INHIBITORS OF NEUTROPHIL ADHESION, ANTIINFLAMMATORY UNIVERSITY OF VERMONT (US) 1998-05-19 US claimed
WO-1998011896-A1 COMBINATION THERAPY FOR REDUCING THE RISKS ASSOCIATED WITH CARDIOVASCULAR DISEASE MERCK & CO., INC. (US) 1998-03-26 WO claimed
WO-1998004259-A1 ANTITHROMBOTIC AND ANTIATHEROGENIC PHARMACEUTICAL COMPOSITION INCLUDING A THIENOPYRIDINE DERIVATIVE AND AN HMG-CoA-REDUCTASE INHIBITOR SANOFI (FR) 1998-02-05 WO claimed
WO-1997044024-A1 NOVEL ARACHIDONIC ACID METABOLITE, 16-HETE UNIVERSITY OF VERMONT (US) 1997-11-27 WO claimed
WO-1997029753-A1 NEW ASSOCIATIONS OF ACTIVE PRINCIPLES CONTAINING CLOPIDOGREL AND AN ANTITHROMBOTIC AGENT SANOFI (FR) 1997-08-21 WO claimed
WO-1996038136-A1 LOCALIZED USE OF NITRIC OXIDE-ADDUCTS TO PREVENT INTERNAL TISSUE DAMAGE NITROMED INC (US) 1996-12-05 WO claimed
US-5576328-A CLOPIDOGREL ELF SANOFI (FR) 1996-11-19 US claimed
WO-1996035416-A1 LOCALIZED USE OF NITRIC OXIDEADDUCTS TO PREVENT INTERNAL TISSUE DAMAGE NITROMED, INC. (US) 1996-11-14 WO claimed
EP-0724436-A1 USE OF NITRIC OXIDE-ADDUCTS TO PREVENT THROMBOSIS ON ARTIFICIAL AND VASCULAR SURFACES BRIGHAM AND WOMEN'S HOSPITAL (US) 1996-08-07 EP claimed
WO-1995007691-A1 USE OF NITRIC OXIDE-ADDUCTS TO PREVENT THROMBOSIS ON ARTIFICIAL AND VASCULAR SURFACES BRIGHAM AND WOMEN'S HOSPITAL (US) 1995-03-23 WO claimed